Monopotassium phosphite

CAS Number: 13977-65-6
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[O-]P(O)=O.[K+]
Molecule Information
Mutagenic: none Tumorigenic: none Irritant: none
Formula
K.H2O3P
Molecular Weight
80.9869
Drug-likeness
-10.048
CAS
13977-65-6
InChI key
TVZAODNOSCFHKT-UHFFFAOYSA-M
SMILES
[O-]P(O)=O.[K+]
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
none
Tumorigenic
none
Handling Watch
Irritant: none | Reproductive effective: none
PropertyValue
CAS Number 13977-65-6
Molecule Name Monopotassium phosphite
Molecular Formula K.H2O3P
SMILES [O-]P(O)=O.[K+]
InChI InChI=1S/K.H3O3P/c;1-4(2)3/h;4H,(H2,1,2,3)/q+1;/p-1
InChI Key TVZAODNOSCFHKT-UHFFFAOYSA-M
CanonicalSyTyLFy 3f3271aca50da8f5
TotalMolweight 120.085
Molecular Weight 80.9869
MonoisotopicMass 80.974157
CLogP -5.2034
CLogS 1.358
H Acceptors 3
H Donors 1
TotalSurfaceArea 48.87
Relative PSA 1
PolarSurfaceArea 83.83
Drug-likeness -10.048
Mutagenic none
Tumorigenic none
Reproductive Effective none
Irritant none
Shape Index 0.75
Fragments 2
Non HAtoms 4
NonCHAtoms 4
Electronegative Atoms 4
StereoCenters 1
Sp3Atoms 3
AcidicOxygens 2
StereoCon racemate

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